PUBCHEM-ZINC04834023 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -0.6320 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 0.1640 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9990 -0.7500 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0300 -1.5040 -1.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 -2.2850 -1.7770 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1150 -2.9410 -3.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4720 -1.3460 -1.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7180 -3.5550 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1870 -4.8170 -0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4240 -5.8130 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1930 -5.5470 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7250 -4.2860 1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4910 -3.2900 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5480 -4.0000 2.6490 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7560 -4.8780 3.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0160 -2.8880 2.8150 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.9720 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 0.7970 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 0.7880 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9030 -0.1470 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9460 -1.4440 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 -1.5450 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 -5.0250 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0090 -6.7990 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 -6.3250 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9090 -2.3060 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END